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Hartree
Results: 165

#	Item
81	A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods Miquel Sola`, Jordi Mestres, Ramon Carbo´, and Miquel Add to Reading List Source URL: dugi-doc.udg.edu Language: English - Date: 2013-05-13 07:54:16 Quantum chemistry Atomic physics Quadratic configuration interaction Ab initio quantum chemistry methods Hartree–Fock method Post-Hartree–Fock Gaussian Density functional theory Dirac Chemistry Computational chemistry Theoretical chemistry
82	THE JOURNAL OF CHEMICAL PHYSICS 125, 024301 共2006兲 Electron localization function at the correlated level Eduard Matito Institut de Química Computacional, Universitat de Girona, 17071 Girona, Catalonia, Spain and D Add to Reading List Source URL: dugi-doc.udg.edu Language: English - Date: 2013-05-13 07:34:30 Quantum mechanics Chemical bonding Atomic physics Computational chemistry Electron Electron localization function Density functional theory Electronic correlation Hartree–Fock method Physics Chemistry Quantum chemistry
83	[removed]karsten Balzer Add to Reading List Source URL: www.cfel.de Language: English - Date: 2013-05-15 18:52:00 Atomic physics Quantum chemistry Theoretical chemistry Computational chemistry Leo Kadanoff Electronic correlation Electron Hartree–Fock method Physics Chemistry Science
84	数理解析研究所講究録 1235 巻 2001 年 [removed]Hartree 方程式の修正波動作用素につぃて神戸大学理学部数学科 Add to Reading List Source URL: www.kurims.kyoto-u.ac.jp Language: Japanese - Date: 2007-03-24 11:00:00
85	Molecular Mechanics: The Ab Initio Foundation Ju Li GEM4 Summer School 2006 Cell and Molecular Mechanics in BioMedicine Add to Reading List Source URL: www.openwetware.org Language: English - Date: 2006-08-21 09:18:05 Charge carriers Atomic physics Quantum electrodynamics Electron Leptons Chemical bond Hartree–Fock method Born–Oppenheimer approximation Matter wave Physics Chemistry Quantum chemistry
86	Are Orbitals Observable? Peter Mulder Abstract: In this paper I discuss the question whether orbitals can be observed or not. I argue that the answer depends on how the terms ‘orbitals’ and ‘observed’ are underst Add to Reading List Source URL: hyle.org Language: English - Date: 2013-03-20 15:09:15 Chemical bonding Atomic physics Theoretical chemistry Computational chemistry Atomic orbital Hartree–Fock method Electron configuration Quantum mechanics Electron Chemistry Physics Quantum chemistry
87	PHYSICAL REVIEW B 87, [removed]Evolution of the persistent spin helix in the presence of Hartree-Fock fields Matthias C. L¨uffe,1 Jeroen Danon,1,2 and Tamara S. Nunner1 1 Add to Reading List Source URL: users.physik.fu-berlin.de Language: English - Date: 2013-03-14 11:44:02 Spintronics Computational chemistry Rotational symmetry Theoretical chemistry Hartree–Fock method Crystal Relaxation Spin Electron Physics Chemistry Atomic physics
88	Basic Books in Science Book 12 Quantum Mechanics of Many-Particle Systems: Add to Reading List Source URL: www.learndev.org Language: English - Date: 2014-05-18 04:22:58 Atomic physics Theoretical chemistry Molecular physics Computational chemistry Atomic orbital Hartree–Fock method Electron Energy level Molecular orbital Chemistry Physics Quantum chemistry
89	Fitting and Using Model Hamiltonian in Add to Reading List Source URL: etheses.bham.ac.uk Language: English - Date: 2012-11-26 12:13:35 Vibronic coupling Diabatic Born–Oppenheimer approximation Multi-configuration time-dependent Hartree Hartree–Fock method Jahn–Teller effect Conical intersection Perturbation theory Chemistry Quantum chemistry Physics
90	Earth/matriX Science Today Physical and Chemical Constants: The Significance of the 1.36c \| 1.366c Fractal Units for the Electron in an Atom Charles William Johnson Extract Add to Reading List Source URL: earthmatrix.com Language: English - Date: 2012-08-13 18:45:41 Quantum chemistry Molecular physics State functions Units of energy Properties of water Thermodynamic temperature Electron Hartree Temperature Chemistry Physics Atomic physics